1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]-3-[3-(methylthio)propyl]thiourea Formula: C19H32N4O2S3 MolecularWeight: 444.67798

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=S)NCCCSC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=S)NCCCSC

InChI

InChI=1S/C19H32N4O2S3/c1-4-23(5-2)28(24,25)16-9-10-18(22-12-6-7-13-22)17(15-16)21-19(26)20-11-8-14-27-3/h9-10,15H,4-8,11-14H2,1-3H3,(H2,20,21,26)